SCHEMBL4405656

SCHEMBL4405656

Nc1ncc(-c2ccc(C(CN3CCCC3)C(=O)O)cc2)cc1-c1nnnn1-c1cccc(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PRCP P42785 1/20 0.36
KCNN4 O15554 4/20 0.35
MAPK1 P28482 11/20 0.35
MET P08581 2/20 0.35
MAP4K4 O95819 1/20 0.33
ACHE P22303 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL985918 0.84 KCNN4 (0.39) KCNN4MAPK1MAP4K4ACHE
SCHEMBL985013 0.83 LRRK2 (0.42) KCNN4MET
SCHEMBL985352 0.82 SLC2A1 (0.41) MAP4K4
SCHEMBL986663 0.82 LRRK2 (0.42) KCNN4ACHE
SCHEMBL985829 0.81 LRRK2 (0.44) KCNN4MET
SCHEMBL987392 0.81 KCNN4 (0.37) KCNN4ACHE
SCHEMBL986434 0.81 KCNN4 (0.37) KCNN4ACHE
SCHEMBL985789 0.81 KCNN4 (0.37) KCNN4ACHE
SCHEMBL983613 0.81 MEN1 (0.38) KCNN4MAPK1METMAP4K4
SCHEMBL4405584 0.81 KCNN4 (0.38) KCNN4MAPK1MAP4K4ACHE

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2004625-B1 C-MET PROTEIN KINASE INHIBITORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS VERTEX PHARMA (US) 2009-12-30 EP claimed